Hi,
Thank you for your answer.
I deleted Ni and Mn alternately, but it didn't work. I obtained a new one
from ICSD, and it is working fine. I have attached it.
Having atoms in the same position was not a problem with other CIF files,
like the FMN attached one. I am fitting now, but I was concern
The site in Mn and Ni in cif is same. It makes your problem.
Make only Mn in cif. I mean that Mn instead of Ni is located.
And run feff. You can get the path related with Mn.
After that, Make another structure in same cif, Ni instead of Mn. You can
get the path of Ni.
Then, use them
2024년 2월 1
Dear all.
I am trying to generate the path for fitting Mn and Ni K edge at
LiMn1.5Ni0.5O2 using cif files from ICSD.
I receive this error:
*Elements: ['Li', 'Mn', 'Ni', 'O']Sites: [2.08337619 6.16682619 6.08352381]
Li:0.980Traceback (most recent calls last): File
"C:\Users\Me\xraylarch_2023